(3E)-3-[4-[(3-azanylpropylamino)methyl]indol-2-ylidene]-1,2-dihydroindazole-6-carbonitrile

Systemtic Name: (3E)-3-[4-[(3-azanylpropylamino)methyl]indol-2-ylidene]-1,2-dihydroindazole-6-carbonitrile Openeye Name: (3E)-3-[4-[(3-aminopropylamino)methyl]indol-2-ylidene]-1,2-dihydroindazole-6-carbonitrile CAS Name: (3E)-3-[4-[(3-aminopropylamino)methyl]-2-indolylidene]-1,2-dihydroindazole-6-carbonitrile IUPAC Name: (3E)-3-[4-[(3-aminopropylamino)methyl]indol-2-ylidene]-1,2-dihydroindazole-6-carbonitrile Traditional Name: (3E)-3-[4-[(3-aminopropylamino)methyl]indol-2-ylidene]indazoline-6-carbonitrile Formula: C20H20N6 MolecularWeight: 344.413

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=C3C4=C(C=C(C=C4)C#N)NN3)C=C2C(=C1)CNCCCN

Isomeric SMILES

C1=CC2=N/C(=C/3\C4=C(C=C(C=C4)C#N)NN3)/C=C2C(=C1)CNCCCN

InChI

InChI=1S/C20H20N6/c21-7-2-8-23-12-14-3-1-4-17-16(14)10-19(24-17)20-15-6-5-13(11-22)9-18(15)25-26-20/h1,3-6,9-10,23,25-26H,2,7-8,12,21H2/b20-19+